(S)-2-Amino-3-methoxypropanoic acid

C₄H₉NO₃CAS 32620-11-4119.12 g/mol

Open in Covalent MOL file

Carboxylic acid Ether Primary amine

Properties

Molecular formula: C₄H₉NO₃
Molar mass: 119.12 g/mol
Exact mass: 119.0582 Da
logP: -0.96Crippen estimate
Polar surface area: 72.5 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 3
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

32620-11-4

SMILES

COC[C@@H](C(=O)O)N

InChIKey

KNTFCRCCPLEUQZ-VKHMYHEASA-N

InChI

InChI=1S/C4H9NO3/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

O-Methylserine

Work with (S)-2-Amino-3-methoxypropanoic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Dl-O-methylserine19794-53-7Stereo not defined

Similar compounds

O-(1,1-Dimethylethyl)-D-serine18783-53-459 % similar O-(1,1-Dimethylethyl)-L-serine18822-58-759 % similar O-Acetylserine5147-00-259 % similar D-Norvaline2013-12-957 % similar Norvaline6600-40-457 % similar (±)-Norvaline760-78-157 % similar (+)-α-Aminobutyric acid1492-24-655 % similar D-α-Aminobutyric acid2623-91-855 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(R)-3-Amino-2-(hydroxymethyl)propanoic acid1217700-75-8 4-Amino-2-hydroxybutanoic acid13477-53-7 Allothreonine144-98-9 2-Methyl-L-serine16820-18-1 Homoserine1927-25-9 D-Allothreonine24830-94-2 L-Allothreonine28954-12-3

Elsewhere

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